71
TITLE: Evaluation of Scoring Functions for Large Scale Application of Virtual Screening in the Identification of Novel Beta-Lactamase Inhibitors
AUTHORS: Vieira, TF; Magalhaes, RP; Cerqueira, NMFSA ; Sérgio F. Sousa ;
PUBLISHED: 2019, SOURCE: 6th IEEE Portuguese Meeting on Bioengineering (ENBENG) in 2019 6TH IEEE PORTUGUESE MEETING IN BIOENGINEERING (ENBENG)
INDEXED IN: Scopus WOS CrossRef
74
TITLE: Molecular dynamic simulations and QM/MM studies addressed to build an active Tryptophan Synthase model. A critical enzyme to treat tuberculosis
AUTHORS: Teixeira, CSS; Sérgio F. Sousa ; Cerqueira, NMFSA ;
PUBLISHED: 2019, SOURCE: 6th IEEE Portuguese Meeting on Bioengineering (ENBENG) in 2019 6TH IEEE PORTUGUESE MEETING IN BIOENGINEERING (ENBENG)
INDEXED IN: Scopus WOS CrossRef
75
TITLE: PLP-dependent enzymes as important biocatalysts for the pharmaceutical, chemical and food industries: a structural and mechanistic perspective
AUTHORS: Rocha, JF; Pina, AF; Sérgio F. Sousa ; Cerqueira, NMFSA ;
PUBLISHED: 2019, SOURCE: CATALYSIS SCIENCE & TECHNOLOGY, VOLUME: 9, ISSUE: 18
INDEXED IN: Scopus WOS CrossRef: 61
76
TITLE: Structural and mechanistic aspects of S-S bonds in the thioredoxin-like family of proteins  Full Text
AUTHORS: Sérgio F. Sousa ; Neves, Rui P. P. ; Waheed, SO; Fernandes, PA ; Ramos, MJ ;
PUBLISHED: 2019, SOURCE: BIOLOGICAL CHEMISTRY, VOLUME: 400, ISSUE: 5
INDEXED IN: Scopus WOS CrossRef: 22
77
TITLE: Structural Characterization of Membrane Protein Dimers
AUTHORS: Preto, AJ; Matos Filipe, P; Koukos, PI; Renault, P; Sérgio F. Sousa ; Moreira, IS;
PUBLISHED: 2019, SOURCE: Methods in molecular biology (Clifton, N.J.), VOLUME: 1958
INDEXED IN: Scopus CrossRef: 1
78
TITLE: Tailoring Specialized Scoring Functions For More Efficient Virtual Screening
AUTHORS: Vieira TF; Magalhaes RP; Sérgio F. Sousa ;
PUBLISHED: 2019, SOURCE: Frontiers in Drug, Chemistry and Clinical Research, VOLUME: 2, ISSUE: 1
INDEXED IN: CrossRef: 6
79
TITLE: VMD Store-A VMD Plugin to Browse, Discover, and Install VMD Extensions  Full Text
AUTHORS: Fernandes, HS ; Sérgio F. Sousa ; Cerqueira, NMFSA ;
PUBLISHED: 2019, SOURCE: JOURNAL OF CHEMICAL INFORMATION AND MODELING, VOLUME: 59, ISSUE: 11
INDEXED IN: Scopus WOS CrossRef: 43
80
TITLE: Analyzing PEGylation through Molecular Dynamics Simulations
AUTHORS: Sérgio F. Sousa ; Peres, J ; Coelho, M; Vieira, TF;
PUBLISHED: 2018, SOURCE: CHEMISTRYSELECT, VOLUME: 3, ISSUE: 29
INDEXED IN: Scopus WOS CrossRef: 14
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